Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.74 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.74 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3618080 | 0.90 | HSD11B1 (0.72) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL3617334 | 0.90 | HSD11B1 (0.75) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL677390 | 0.85 | HSD11B1 (1.00) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL27534009 | 0.85 | HSD11B1 (0.69) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL3623421 | 0.84 | HSD11B1 (0.68) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL3616536 | 0.84 | HSD11B1 (0.68) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL3618123 | 0.82 | HSD11B1 (0.64) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL3614035 | 0.82 | HSD11B1 (0.77) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL3612961 | 0.81 | HSD11B1 (0.65) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 | |
| SCHEMBL3619776 | 0.81 | HSD11B1 (0.85) | HSD11B1HSD17B1HSD17B2KMT2AMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019075394-A1 | COMPOUNDS FOR TREATMENT OF EMOTIONAL/PSYCHOLOGICAL SYMPTOMS IN FRAGILE X SYNDROME | VANDERKLISH PETER (US) | 2019-04-18 | — | — | WO | disclosed |